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4-(4-Butyl-1-cyclohexen-1-yl)benzonitrile

View entire compound with spectra: 2 MS (GC)

4-(4-Butyl-1-cyclohexen-1-yl)benzonitrile
SpectraBase Compound ID DuaXIZrZgVE
InChI InChI=1S/C17H21N/c1-2-3-4-14-5-9-16(10-6-14)17-11-7-15(13-18)8-12-17/h7-9,11-12,14H,2-6,10H2,1H3
InChIKey OGUCEYMBLPEMJZ-UHFFFAOYSA-N
Mol Weight 239.36 g/mol
Molecular Formula C17H21N
Exact Mass 239.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FdG2gxTLiEW
Name 4-(4-Butyl-1-cyclohexen-1-yl)benzonitrile
CAS Registry Number 72114-68-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21N
InChI InChI=1S/C17H21N/c1-2-3-4-14-5-9-16(10-6-14)17-11-7-15(13-18)8-12-17/h7-9,11-12,14H,2-6,10H2,1H3
InChIKey OGUCEYMBLPEMJZ-UHFFFAOYSA-N
Molecular Weight 239.362 g/mol
SMILES C(#N)c1ccc(cc1)C=1CCC(CC1)CCCC
SPLASH splash10-014i-6900000000-df401ff198cb55f7b070
Synonyms 4-(4-butyl-1-cyclohexenyl)benzonitrile 4-(4-butylcyclohexen-1-yl)benzenecarbonitrile 4-(4-butylcyclohexen-1-yl)benzonitrile Benzonitrile, 4-(4-butyl-1-cyclohexen-1-yl)-
Wiley ID 1475838